N5-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C23H22N6O2S MolecularWeight: 446.52478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4)C

InChI

InChI=1S/C23H22N6O2S/c1-14-12-15(2)26-23(25-14)32-18-10-8-16(9-11-18)27-22(31)19-13-20(21(24)30)29(28-19)17-6-4-3-5-7-17/h3-12,20H,13H2,1-2H3,(H2,24,30)(H,27,31)